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Home > Pyridines > 143870-31-9
143870-31-9 | Pyridinium, 2,4-dimethyl-1-phenyl-6-undecyl-, perchlorate (1:1)
CAS No: 143870-31-9 Catalog No: AG001IJ3 MDL No:
Product Description
Catalog Number:
AG001IJ3
Chemical Name:
Pyridinium, 2,4-dimethyl-1-phenyl-6-undecyl-, perchlorate (1:1)
CAS Number:
143870-31-9
Molecular Formula:
C24H36ClNO4
Molecular Weight:
437.9999
IUPAC Name:
2,4-dimethyl-1-phenyl-6-undecylpyridin-1-ium;perchlorate
InChI:
InChI=1S/C24H36N.ClHO4/c1-4-5-6-7-8-9-10-11-13-18-24-20-21(2)19-22(3)25(24)23-16-14-12-15-17-23;2-1(3,4)5/h12,14-17,19-20H,4-11,13,18H2,1-3H3;(H,2,3,4,5)/q+1;/p-1
InChI Key:
GGNPHSLZRGLOHH-UHFFFAOYSA-M
SMILES:
[O-][Cl](=O)(=O)=O.CCCCCCCCCCCc1cc(C)cc([n+]1c1ccccc1)C
Properties
Complexity:
416
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
437.233g/mol
Formal Charge:
0
Heavy Atom Count:
30
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
438.005g/mol
Monoisotopic Mass:
437.233g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
78.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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